"Twins" retrives similar metabolites in chemical structure.
last update : 2020.01.06
KNApSAcK CID : ex.) C00000001


and

Similarity (%) : ex.) 98
% or more




INPUT WORD = C00011442 , 50% or more
[ Metabolite Name : Davana ether ]
Number of matched data : 139

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00011436 Artedouglasiaoxide 89.19
C00011465 Isodavanone
[2alpha(E),5alpha]-(+)-(5-Ethenyltetrahydro-5-methyl-2-furanyl)-6-methyl-4-hepten-3-one		 88.57
C00011506 Artemone 88.57
C00012468 Zerumbone oxide 88.57
C00011463 [2R-[2alpha(2R*,4E),5beta]]-2-(5-Ethenyltetrahydro-5-methyl-2-furanyl)-6-hydroxy-6-methyl-4-hepten-3-one 86.11
C00020369 11,12-Epoxy-10(14)-guaien-4-ol 86.11
C00042884 Pulicanadienol
(+)-Pulicanadienol		 86.11
C00011378 2,10-Dihydroxy-2,6,10-trimethyl-3,6,11-dodecatrien-5-one 85.71
C00011434 Caparrapitriol 85.71
C00011443 Davanone 85.71
C00011575 alpha-Snyderol 85.71
C00012853 Isocorymbolone
[4R-(4a,4aa,6b,8a,8ab)]-Octahydro-8-hydroxy-4,8a-dimethyl-6-(1-methylethenyl)-1(2H)-naphthalenone		 85.71
C00020245 4-Hydroxy-10(14)-oplopen-3-one 85.71
C00020385 Dolichlasin 85.71
C00020388 Jatamansic acid 85.71
C00020405 Pleocarpenene 85.71
C00021712 Laurenone B 85.71
C00021910 Cyperolone 85.71
C00029369 10-epi-gamma-Eudesmol
(-)-10-epi-gamma-Eudesmol		 85.71
C00044885 Litseagermacrane
(+)-Litseagermacrane		 85.71
C00044886 Litseahumulane A
(-)-Litseahumulane A		 85.71
C00046403 Sesquichamaenol 85.71
C00047658 2-Keto-5-hydroxyguai-3,11-diene
(+)-2-Keto-5-hydroxyguai-3,11-diene		 85.71
C00049304 Sootepdienone
(+)-Sootepdienone		 85.71
C00050285 Hydroxycolorenone 85.71
C00012793 Isochenopotriol
[1S-(1alpha,2beta,4abeta,7alpha)]-1,2,3,4,4a,5,6,7-Octahydro-2-(1-hydroxy-1-methylethyl)-4a,8-dimethyl-1,7-naphthalenediol		 83.78
C00013101 [1aR-(1aalpha,3abeta,6beta,8abeta,8balpha)]-Octahydro-3a,7,7,8b-tetramethyl-2H-6,8a-methanooxireno[i][1]benzoxepin 83.78
C00013102 [1aS-(1aalpha,3aalpha,6alpha,8aalpha,8balpha)]-Octahydro-3a,7,7,8b-tetramethyl-2H-6,8a-methanooxireno[i][1]benzoxepin 83.78
C00021613 2-Chloro-3-hydroxy-7-chamigren-9-one 83.78
C00029661 Alismorientol B 83.78
C00036858 Caespitenone 83.78
C00003124 Daucol 83.33
C00011718 Ageratriol 83.33
C00012477 12,12-Dimethyl-9-methylene-5-Oxatricyclo[8.2.0.04,6]dodecane-4-methanol 83.33
C00012741 [1aR-(1aalpha,2alpha,4aalpha,7alpha,8aS*)]-Octahydro-1a,4a-dimethyl-7-(1-methylethenyl)-3H-naphth[1,8a-b]oxiren-2-ol
4alpha,5alpha-Epoxy-11-eudesmen-3alpha-ol		 83.33
C00017494 2,5-Epoxy-1(6)-brasilen-9-ol 83.33
C00020364 3beta-Hydroxyliguloxide 83.33
C00021116 4beta,10alpha-Dihydroxyaromadendrane
(-)-4beta,10alpha-Dihydroxyaromadendrane
Aromadendrane-4beta,10alpha-diol		 83.33
C00021207 Alloaromadendrane-4alpha,10beta-diol 83.33
C00021234 Sesquivarodiol 83.33
C00023639 Chokol E
(3R)-6-[1R,2S,3R)-3-Hydroxy-2,3-dimethylcyclopentyl]-2-methylhepta-6-ene-2,3-diol
(-)-Chokol E		 83.33
C00029669 alpha-Guaiol 83.33
C00031608 Aromadendrane-4beta,10beta-diol 83.33
C00035096 ent-4beta,10alpha-Dihydroxyaromadendrane 83.33
C00037336 Isoomphadione
(-)-Isoomphadione		 83.33
C00042588 Hodgsonox
(+)-Hodgsonox		 83.33
C00003149 Hydroxyisopatchoulenone 82.86
C00003185 Seiricardine A 82.86
C00011395 (E,E)-(-)-10-hydroxy-2,6,10-trimethyl-2,5,7,11-Dodecatetraen-4-one 82.86
C00011402 Rhipocephenal 82.86
C00011426 2,6,10-Trimethyl-3,6,11-dodecatriene-2,10-diol 82.86
C00011446 [2S-[2alpha,5alpha(E)]]-5-(1,5-Dimethyl-1,4-hexadienyl)-2-ethenyltetrahydro-2-methylfuran 82.86
C00011447 [2S-[2alpha,5beta(E)]]-5-(1,5-Dimethyl-1,4-hexadienyl)-2-ethenyltetrahydro-2-methylfuran 82.86
C00011519 Chokol F
(-)-Chokol F		 82.86
C00011520 Chokol B 82.86
C00011559 beta-Monocyclonerolidol 82.86
C00011578 Dactylenol 82.86
C00011579 Dactyloxene B 82.86
C00011580 alpha-Ethenyl-alpha,2,3,6-tetramethyl-2,5-cyclohexadiene-1-propanol 82.86
C00011585 Striatol 82.86
C00011673 Heterocurvistone 82.86
C00011701 [1S-(1R*,4S*,5E,7R*)]-4-Methyl-10-methylene-7-(1-methylethyl)-5-cyclodecene-1,4-diol 82.86
C00011712 [1R-(1R*,2E,4R*,7E)]-4-Hydroxy-alpha,alpha,4,8-tetramethyl-2,7-cyclodecadiene-1-methanol 82.86
C00011733 (+)-Germacrenone
Germacrenone		 82.86
C00012015 Periplocadiol
(1alpha,2alpha,4alpha,6alpha)-(-)-1-Ethenyl-2-hydroxy-4,6-bis(1-methylethenyl)-cyclohexanemethanol		 82.86
C00012460 (1R*,3E,7E,11S*)-(+)-5,5,8-Trimethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene-1-methanol
1alpha,10beta-Epoxy-alpha-humulen-14-ol		 82.86
C00012461 (1R*,3E,7E,11R*)-(+)-5,5,8-Trimethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene-1-carboxaldehyde
6alpha,7beta-Epoxy-2,9-humuladien-14-al		 82.86
C00012478 Caryophyllenol I 82.86
C00012479 Caryophyllenol II 82.86
C00012502 Bicyclohumulenedione
[1S-(1R*,5S*,10R*)]-1,5,8,8-tetramethylbicyclo[8.1.0]undecane-2,6-dione		 82.86
C00012740 Cyperol 82.86
C00012753 (+)-Coralloidin E
Coralloidin E
trans-(+)-4,4a,5,6,7,8-Hexahydro-alpha,alpha,4a,8-tetramethyl-2-naphthalenemethanol		 82.86
C00012765 Cryptomeridiol
Proximadiol
Selina-4,7-diol
Selinane-4alpha,11-diol		 82.86
C00012766 (-)-10-epi-5beta,11-Dihydroxyeudesmane
[2R-(2alpha,4abeta,8alpha,8aalpha)]-Decahydro-8a-hydroxy-a,a,4a,8-tetramethyl-2-naphthalenemethanol		 82.86
C00012781 [2R-(2alpha,4aalpha,5alpha,8abeta)]-Decahydro-5-hydroxy-a,a,4a-trimethyl-8-methylene-2-naphthalenemethanol 82.86
C00012782 (+)-Pterocarpol
Eudesm-4(14)-ene-2a,11-diol
[2R-(2alpha,4aalpha,6beta,8abeta)]-decahydro-6-hydroxy-alpha,alpha,4a-trimethyl-8-methylene-2-naphthalenemethanol		 82.86
C00012783 beta-Chenopodiol
4(14)-Eudesmene-6a,11-diol
[1R-(1alpha,2beta,4abeta,8aalpha)]-Decahydro-1-hydroxy-alpha,alpha,4a-trimethyl-8-methylene-2-naphthalenemethanol		 82.86
C00012785 Arctiol
[2S-(2alpha,3beta,4aalpha,8abeta)]-Decahydro-3-hydroxy-alpha,alpha,4a-trimethyl-8-methylene-2-naphthalenemethanol		 82.86
C00012786 Kudtdiol
[2R-[2alpha(R*),4aalpha,8abeta]]-2-(Decahydro-4a-methyl-8-methylene-2-naphthalenyl)-1,2-propanediol		 82.86
C00012788 (-)-Oplodiol
Oplodiol
[1S-(1alpha,4alpha,4aalpha,8abeta)]-1,2,3,4,4a,5,8,8a-Octahydro-1,4a-dimethyl-7-(1-methylethyl)-1,4-naphthalenediol		 82.86
C00012789 2-(1,4,4a,5,6,7,8,8a-Octahydro-4a,8-dimethyl-2-naphthalenyl)-1,2-propanediol 82.86
C00012790 alpha-Corymbolol
1,[1S-(1alpha,4beta,4aalpha,6beta,8abeta)]-Octahydro-4,8a-dimethyl-6-(1-methylethenyl)-4a(2H)-naphthalenediol		 82.86
C00012791 Corymbolone
[4S-(4alpha,4abeta,6alpha,8aalpha)]-Octahydro-4a-hydroxy-4,8a-dimethyl-6-(1-methylethenyl)-1(2H)-naphthalenone		 82.86
C00012810 Rosifoliol
(+)-Rosifoliol
[2R-(2alpha,4abeta,8beta)]-2,3,4,4a,5,6,7,8-octahydro-alpha,alpha,4a,8-tetramethyl-2-naphthalenemethanol		 82.86
C00012818 (2R-trans)-3,4,4a,5,6,7-Hexahydro-2-hydroxy-4a,8-dimethyl-2-(1-methylethyl)-1(2H)-naphthalenone
7alpha-Hydroxyneoacolamone		 82.86
C00013103 Deoxybaimuxinol
Dihydro-beta-agarofuran
trans-Dihydroagarofuran
[3R-(3alpha,5aalpha,9alpha,9aalpha)]-Octahydro-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin		 82.86
C00016995 Warburgiadione
Eremophila-1,7(11),9-triene-3,8-dione		 82.86
C00017014 Hydroxyeremophilone 82.86
C00020064 Isocalamendiol 82.86
C00020093 1,4-Epoxycadinane 82.86
C00020134 gamma-Muurolen-15-oic acid 82.86
C00020244 1(10)-Oplopene-4,9-dione 82.86
C00020407 Karatavin 82.86
C00020412 Cucumadiol 82.86
C00020415 1-Hydroxy-4,11-guaiadien-3-one 82.86
C00020416 Procurcumenol 82.86
C00020417 11-Hydroxy-4-guaien-3-one 82.86
C00020641 1beta-Hydroperoxy-4(15),5E,10(14)-germacratriene 82.86
C00021298 Valerenenol 82.86
C00021299 Isovalerenenol 82.86
C00021323 Marsupellone 82.86
C00021342 Deoxypinguisone 82.86
C00021417 Carota-1,4-beta-oxide 82.86
C00021424 Aphanamol II 82.86
C00021425 Aphanamol I 82.86
C00021596 Nidifidiene 82.86
C00021711 Laurenone A 82.86
C00021730 8,14-Cedranoxide 82.86
C00021778 Poitediol 82.86
C00021915 Dipterolone 82.86
C00022015 Ligucyperonol 82.86
C00022330 Periplanone A 82.86
C00029437 2,7-dihydroxy-11,12-dehydrocalamenene
(-)-2,7-dihydroxy-11,12-dehydrocalamenene		 82.86
C00030026 Cucumegastigmane I 82.86
C00031161 Rhombidiol
(-)-Rhombidiol		 82.86
C00031442 Zerumbone epoxide 82.86
C00031641 Cadin-10(14)-ene-4beta,5alpha-diol
(-)-Cadin-10(14)-ene-4beta,5alpha-diol		 82.86
C00031766 Epicubebol
epi-Cubebol
4-epi-Cubebol		 82.86
C00031907 Isokhusinodiol
(-)-Isokhusinodiol		 82.86
C00033700 Carissone
(+)-Carissone		 82.86
C00035496 4,5-epi-Cryptomeridiol 82.86
C00035842 iso-Acorone 82.86
C00035992 (+)-6,11-Epoxy-isodaucane 82.86
C00036128 Isovaleroyloxylinalool 82.86
C00037538 Nardoguaianone J
(-)-Nardoguaianone J		 82.86
C00037539 Nardoguaianone K
(+)-Nardoguaianone K		 82.86
C00037985 Verticillatol
(-)-Verticillatol		 82.86
C00038117 10alpha,11-Dihydroxyamorph-4-ene 82.86
C00040307 Sinugibberodiol
(-)-Sinugibberodiol		 82.86
C00041773 Pleodendione 82.86
C00042493 epi-gamma-Eudesmol
(-)-epi-gamma-Eudesmol		 82.86
C00043970 Terrefuranone 82.86
C00043973 Teucladiol 82.86
C00044740 Eleganodiol 82.86
C00044887 Litseahumulane B
(-)-Litseahumulane B		 82.86
C00045867 Drimane-8alpha,11-diol 82.86
C00046150 Millecrone B 82.86
C00049060 1,2-Dehydro-3-oxo-beta-gurjunene
(+)-1,2-Dehydro-3-oxo-beta-gurjunene		 82.86
C00050331 Artabotrol 82.86
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